0 mol 9 unq 0 iso 0 dist 9.27637 6.11048 6.00657 5.67536 5.71201 6.59312 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.93188 8.23075 4.21283 5.11617 4.90592 7.85986 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 4.93188 4.7841 4.97191 4.50066 8.78859 7.03544 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 4.93188 4.7841 4.97191 5.11617 4.90592 4.30252 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.44506 7.98005 12.4814 10.797 11.5353 9.82851 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 8.44506 7.98005 12.4814 10.9837 9.5053 9.11311 numMergedOcc 0
6 mol 28 unq 0 iso 0 dist 7.28416 8.95154 6.37119 8.4285 7.40415 5.19518 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 7.27383 6.79356 6.21346 5.85698 6.62229 6.41008 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.26086 7.92856 8.67903 14.1056 14.094 9.90672 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.26086 7.92856 8.67903 14.3413 16.0369 7.55367 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 6.98934 7.60162 9.53672 7.45148 11.9591 6.21165 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 7.99623 7.60162 8.90156 7.45148 9.9151 6.21165 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 8.80896 8.57739 5.46636 8.8365 11.0482 8.65859 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 6.20182 7.93088 5.21512 4.20425 7.14263 5.67088 numMergedOcc 0
14 mol 162 unq 1 iso 0 dist 6.20182 7.93088 5.21512 6.45822 11.0559 9.61332 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 7.24795 5.90765 9.28201 8.98536 15.9486 9.31569 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 7.24795 5.90765 9.28201 7.30024 7.46987 8.72743 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 5.60393 7.13783 12.0319 9.55992 14.7904 7.75318 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 8.70977 6.23183 11.5047 7.67029 15.4538 5.17607 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 7.83711 8.25985 6.20756 4.9377 6.57921 9.78273 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 8.15467 5.4557 10.6472 6.93678 10.7256 7.08328 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 8.60026 8.24356 11.1232 6.18925 14.568 9.41212 numMergedOcc 0
